PUBCHEM-ZINC06020368 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 1 0 0 0 0 0999 V2000 -0.3340 1.3470 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.1480 0.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9330 -0.7140 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -0.5400 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -2.0000 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.7780 -0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -0.5300 1.5310 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.1130 2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -0.5220 4.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5420 -0.0390 4.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 0.0650 5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -0.6910 5.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -1.9750 4.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -2.5640 3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.5460 5.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -1.9300 6.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -4.0470 5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 1.9630 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 1.5900 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 1.6540 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 0.0210 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.2360 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 0.9670 2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.6230 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -4.4500 5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -4.3400 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -4.4620 6.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.2410 -2.7700 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2080 1.2590 5.6710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 29 -1 M END